N-(3-methylbutyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-phenyl-prop-2-enamide

Systemtic Name: N-(3-methylbutyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-phenyl-prop-2-enamide Openeye Name: N-isopentyl-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-3-phenyl-prop-2-enamide CAS Name: N-(3-methylbutyl)-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-3-phenyl-2-propenamide IUPAC Name: N-(3-methylbutyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-phenylprop-2-enamide Traditional Name: N-isoamyl-N-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]-3-phenyl-acrylamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)C(=O)C=CC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O2S/c1-15(2)11-12-23(13-18(24)22-20-21-16(3)14-26-20)19(25)10-9-17-7-5-4-6-8-17/h4-10,14-15H,11-13H2,1-3H3,(H,21,22,24)